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5-hydroxy-2-iodomethyl-2,3-dihydroanthra[1,2-a]furan-6,11-dione
SpectraBase Compound ID ApVdUWuCqud
InChI InChI=1S/C17H11IO4/c18-7-9-5-8-6-12(19)13-14(17(8)22-9)16(21)11-4-2-1-3-10(11)15(13)20/h1-4,6,9,19H,5,7H2
InChIKey PTEGKBOIDDKEBK-UHFFFAOYSA-N
Mol Weight 406.18 g/mol
Molecular Formula C17H11IO4
Exact Mass 405.970204 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jQGXfspyvs
Name 5-hydroxy-2-iodomethyl-2,3-dihydroanthra[1,2-a]furan-6,11-dione
Comments Less than 3 mono-isotopic peaks
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Formula C17H11IO4
InChI InChI=1S/C17H11IO4/c18-7-9-5-8-6-12(19)13-14(17(8)22-9)16(21)11-4-2-1-3-10(11)15(13)20/h1-4,6,9,19H,5,7H2
InChIKey PTEGKBOIDDKEBK-UHFFFAOYSA-N
Molecular Weight 406.175 g/mol
SMILES Oc1c2c(C(c3c(cccc3)C2=O)=O)c2c(c1)CC(O2)CI
SPLASH splash10-0a6r-0040900000-d284151046a35df228ae
Source of Spectrum B-47-1561-0
Wiley ID 1371943